4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-3,4-dihydroquinoxalin-2(1H)-one
4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | D356-2107 |
| Compound Name: | 4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 431.48 |
| Molecular Formula: | C21 H22 F N3 O4 S |
| Smiles: | C1CN(CCC1C(N1CC(Nc2ccccc12)=O)=O)S(Cc1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7311 |
| logD: | 1.7298 |
| logSw: | -2.5064 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.99 |
| InChI Key: | MSYMDVQIOZUUKD-UHFFFAOYSA-N |